Vitas-M small molecule compound
N-{(1Z)-3-(dimethylamino)-1-[3-(4-iodophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Catalog ID
STK543716
SMILES Cc1ccc(cc1)C(=O)N/C(=C\c1cn(nc1c1ccc(cc1)I)c1ccccc1)/C(=O)N(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H25IN4O2 MW 576.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25IN4O2/c1-19-9-11-21(12-10-19)27(34)30-25(28(35)32(2)3)17-22-18-33(24-7-5-4-6-8-24)31-26(22)20-13-15-23(29)16-14-20/h4-18H,1-3H3,(H,30,34)/b25-17-InChIKey
MKNOTQCUEHEBJY-UQQQWYQISA-NSynonyms
(2Z)3(3(4IODOPHENYL)1PHENYLPYRAZOL4YL)NNDIMETHYL2((4METHYLPHENYL)CARBONYLAMINO)PROP2ENAMIDE
(Z)N(3(dimethylamino)1(3(4iodophenyl)1phenyl1Hpyrazol4yl)3oxoprop1en2yl)4methylbenzamide
CC1=CC=C(C=C1)C(=O)NC(=CC2=CN(N=C2C3=CC=C(C=C3)I)C4=CC=CC=C4)C(=O)N(C)C
Cc1ccc(cc1)C(=O)NC(=Cc1cn(nc1c1ccc(cc1)I)c1ccccc1)C(=O)N(C)C
InChI=1SC28H25IN4O2c11991121(121019)27(34)3025(28(35)32(2)3)17221833(247546824)3126(22)20131523(29)161420h418H13H3(H3034)b2517
MFCD03295237
N((1Z)3(dimethylamino)1(3(4iodophenyl)1phenyl1Hpyrazol4yl)3oxoprop1en2yl)4methylbenzamide
N((Z)3(dimethylamino)1(3(4iodophenyl)1phenylpyrazol4yl)3oxoprop1en2yl)4methylbenzamide
ZINC000097966581
ZINC97966581
Check stock
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Check stock on Vitas-MAvailable files
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